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SMILES: CNc1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)ncc1Cl

InChI Key: InChIKey=AMQCBROKDRYSQO-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50396158   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))
BDBM50396158
PNG
(CHEMBL2171748)
Show SMILES CNc1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)ncc1Cl
Show InChI InChI=1S/C16H18ClN5O2/c1-18-14-13(17)10-19-16(21-14)20-12-4-2-11(3-5-12)15(23)22-6-8-24-9-7-22/h2-5,10H,6-9H2,1H3,(H2,18,19,20,21)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of LRRK2


J Med Chem 55: 5536-45 (2012)


Article DOI: 10.1021/jm300452p
BindingDB Entry DOI: 10.7270/Q2RR20CQ
More data for this
Ligand-Target Pair
Tyrosine-protein kinase JAK2


(Homo sapiens (Human))
BDBM50396158
PNG
(CHEMBL2171748)
Show SMILES CNc1nc(Nc2ccc(cc2)C(=O)N2CCOCC2)ncc1Cl
Show InChI InChI=1S/C16H18ClN5O2/c1-18-14-13(17)10-19-16(21-14)20-12-4-2-11(3-5-12)15(23)22-6-8-24-9-7-22/h2-5,10H,6-9H2,1H3,(H2,18,19,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of JAK2


J Med Chem 55: 5536-45 (2012)


Article DOI: 10.1021/jm300452p
BindingDB Entry DOI: 10.7270/Q2RR20CQ
More data for this
Ligand-Target Pair